2-methoxy-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid


Chemical Name: 2-methoxy-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid
CAS Number: 1226776-93-7
Product Number: AG0017LB(AGN-PC-02LGRP)
Synonyms:
MDL No: MFCD16495884
Molecular Formula: C6H4F3NO3S
Molecular Weight: 227.1611

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
227.157g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
2
Exact Mass:
226.986g/mol
Monoisotopic Mass:
226.986g/mol
Topological Polar Surface Area:
87.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
235
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Methoxy-4-(trifluoromethyl)thiazole-5-carboxylic acid, commonly known as $name$, plays a crucial role in chemical synthesis as a versatile building block. Its unique structure containing a trifluoromethyl group and a thiazole ring makes it a valuable intermediate for synthesizing a wide range of complex organic compounds.In organic synthesis, $name$ is frequently used as a precursor molecule for creating pharmaceuticals, agrochemicals, and other specialty chemicals. The trifluoromethyl group enhances the lipophilicity and metabolic stability of the resulting molecules, making them attractive candidates for drug development.Moreover, the thiazole ring in $name$ is a key structural motif found in many biologically active compounds, making it a valuable starting material for the synthesis of various heterocyclic compounds with diverse biological activities.In summary, the application of 2-Methoxy-4-(trifluoromethyl)thiazole-5-carboxylic acid in chemical synthesis is indispensable for designing and preparing novel compounds with potential applications in pharmaceuticals, materials science, and agrochemistry.